UCSF

ZINC02572329

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 8 No

Popular Name: 2-Chloro-5-chloromethylthiazole 2-Chloro-5-chloromethylthiazole

Find On: PubMed — Wikipedia — Google

CAS Numbers: 105827-91-6 , 2-Chloro-5-Chloromethylthiazole , 50398-77-1 , [105827-91-6]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.48 -0.73 -4.26 0 1 0 13 168.048 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 29-31° Matrix Scientific
MP 31 - 33 Enamine Building Blocks
MP 31...33 Enamine Building Blocks
MP 31° Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
PUBCHEM_PATENT_ID EP0192060A1; EP0235725A2; EP0235725B1; EP0259738A2; EP0259738B1; EP0260560A1; EP0277317A1; EP0285985A1; EP0302389A2; EP0302389B1; EP0315826A1; EP0315826B1; EP0364844A1; EP0364844B1; EP0383091A1; EP0386565A1; EP0386565B1; EP0422369A2; EP0422369A3; EP042503 IBM Patent Data
Warnings IRRITANT Matrix Scientific
Warnings Toxic/Corrosive/Refrigerate Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.